Vitas-M small molecule compound
methyl 2-({[(2E)-3-(4-methylphenyl)prop-2-enoyl]carbamothioyl}amino)benzoate
Catalog ID
STL063300
SMILES COC(=O)c1ccccc1NC(=S)NC(=O)/C=C/c1ccc(cc1)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H18N2O3S MW 354.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O3S/c1-13-7-9-14(10-8-13)11-12-17(22)21-19(25)20-16-6-4-3-5-15(16)18(23)24-2/h3-12H,1-2H3,(H2,20,21,22,25)/b12-11+InChIKey
MWQRPQMVFIFVRV-VAWYXSNFSA-NSynonyms
CC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=CC=C2C(=O)OC
COC(=O)c1ccccc1NC(=S)NC(=O)C=Cc1ccc(cc1)C
InChI=1SC19H18N2O3Sc1137914(10813)111217(22)2119(25)2016643515(16)18(23)242h312H12H3(H220212225)b1211+
methyl2((((2E)3(4methylphenyl)prop2enoyl)carbamothioyl)amino)benzoate
METHYL2((((3(4METHYLPHENYL)ACRYLOYL)AMINO)CARBOTHIOYL)AMINO)BENZOATE
METHYL2(((E)3(4METHYLPHENYL)PROP2ENOYL)CARBAMOTHIOYLAMINO)BENZOATE
MFCD05655269
ZINC000002136537
ZINC02136537
ZINC2136537
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